Vitas-M small molecule compound
[1-(2-{[5-(butylsulfanyl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)-1H-1,2,4-triazol-4-ium-4-yl](nitro)azanide
Catalog ID
STK673396
SMILES [O-][N+](=O)[N-][n+]1cn(nc1)CC(=O)Nc1nnc(s1)SCCCC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C10H14N8O3S2 MW 358.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H14N8O3S2/c1-2-3-4-22-10-14-13-9(23-10)12-8(19)5-16-7-17(6-11-16)15-18(20)21/h6-7H,2-5H2,1H3,(H,12,13,19)InChIKey
NZZUGOPIOGUNSK-UHFFFAOYSA-NSynonyms
(1(2((5(butylsulfanyl)134thiadiazol2yl)amino)2oxoethyl)1H124triazol4ium4yl)(nitro)azanide
(1(2((5BUTYLSULFANYL134THIADIAZOL2YL)AMINO)2OXOETHYL)124TRIAZOL4IUM4YL)NITROAZANIDE
(O)(N+)(=O)(N)(n+)1cn(nc1)CC(=O)Nc1nnc(s1)SCCCC
CCCCSC1=NN=C(S1)NC(=O)CN2C=(N+)(C=N2)(N)(N+)(=O)(O)
InChI=1SC10H14N8O3S2c1234221014139(2310)128(19)516717(61116)1518(20)21h67H25H21H3(H121319)
MFCD01304678
ZINC000012410840
ZINC02905623
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